Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.31 |
| ▸ | TAS2R31 | P59538 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6556309 | 1.00 | IDO1 (0.43) | IDO1ACHEALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL6556312 | 1.00 | IDO1 (0.43) | IDO1ACHEALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL6556331 | 0.90 | IDO1 (0.41) | IDO1ACHECYP3A4HTR2C | |
| SCHEMBL6556322 | 0.90 | IDO1 (0.41) | IDO1ACHECYP3A4HTR2C | |
| SCHEMBL6556326 | 0.90 | IDO1 (0.41) | IDO1ACHECYP3A4HTR2C | |
| SCHEMBL13213819 | 0.90 | IDO1 (0.41) | IDO1ACHECYP3A4HTR2C | |
| SCHEMBL6556422 | 0.87 | IDO1 (0.58) | IDO1ALDH1A1KDM4ESMN1; SMN2PTGS2 | |
| SCHEMBL6556426 | 0.87 | IDO1 (0.58) | IDO1ALDH1A1KDM4ESMN1; SMN2PTGS2 | |
| SCHEMBL6556416 | 0.87 | IDO1 (0.58) | IDO1ALDH1A1KDM4ESMN1; SMN2PTGS2 | |
| Fumaric Acid SCHEMBL6556498 | 0.81 | IDO1 (0.52) | IDO1ALDH1A1KDM4ESMN1; SMN2PTGS2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6310208-B1 | Serotonin receptor binding benzo[e]isoindoles and benzo[h]isoquinolines | HOFFMANN-LA ROCHE INC. | 2001-10-30 | — | — | US | claimed |
| EP-0958285-B1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | HOFFMANN LA ROCHE (CH) | 2004-01-07 | — | — | EP | disclosed |
| US-6310208-B1 | Serotonin receptor binding benzo[e]isoindoles and benzo[h]isoquinolines | HOFFMANN-LA ROCHE INC. | 2001-10-30 | — | — | US | disclosed |
| EP-0958285-A1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | F.HOFFMANN-LA ROCHE AG (CH) | 1999-11-24 | — | — | EP | disclosed |
| WO-1998030546-A1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | F. HOFFMANN-LA ROCHE AG (CH) | 1998-07-16 | — | — | WO | disclosed |